| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | c1c(cc(c(c1)C(CC(NO)=O)CC(=O)NCCCS)Cl)Cl |
| InChI | InChI | 1.03 | InChI=1S/C14H18Cl2N2O3S/c15-10-2-3-11(12(16)8-10)9(7-14(20)18-21)6-13(19)17-4-1-5-22/h2-3,8-9,21-22H,1,4-7H2,(H,17,19)(H,18,20)/t9-/m0/s1 |
| InChIKey | InChI | 1.03 | IGKGDGVXYQXVLZ-VIFPVBQESA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | ONC(=O)C[C@H](CC(=O)NCCCS)c1ccc(Cl)cc1Cl |
| SMILES | CACTVS | 3.385 | ONC(=O)C[CH](CC(=O)NCCCS)c1ccc(Cl)cc1Cl |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | c1cc(c(cc1Cl)Cl)[C@@H](CC(=O)NCCCS)CC(=O)NO |
| SMILES | OpenEye OEToolkits | 2.0.7 | c1cc(c(cc1Cl)Cl)C(CC(=O)NCCCS)CC(=O)NO |
